| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:59:03 UTC |
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| Update Date | 2025-03-25 00:53:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02199069 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H9F3O2 |
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| Molecular Mass | 218.0555 |
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| SMILES | CC(=O)OCc1ccc(C(F)(F)F)cc1 |
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| InChI Key | RGXMQOMQGUZTOV-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzyloxycarbonyls |
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| Direct Parent | benzyloxycarbonyls |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl fluoridescarbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridestrifluoromethylbenzenes |
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| Substituents | benzyloxycarbonylcarbonyl groupalkyl fluorideorganofluoridecarboxylic acid derivativeorganohalogen compoundaromatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteralkyl halidehydrocarbon derivativetrifluoromethylbenzeneorganooxygen compound |
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